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9-Hexadecenoic acid, eicosyl ester, (Z)-
SpectraBase Compound ID EpYQDfGvZ2R
InChI InChI=1S/C36H70O2/c1-3-5-7-9-11-13-15-17-18-19-20-21-23-25-27-29-31-33-35-38-36(37)34-32-30-28-26-24-22-16-14-12-10-8-6-4-2/h14,16H,3-13,15,17-35H2,1-2H3/b16-14-
InChIKey FIETWBRPSYJUOM-PEZBUJJGSA-N
Mol Weight 535.0 g/mol
Molecular Formula C36H70O2
Exact Mass 534.537581 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID jcxD83Yjv0
Name 9-Hexadecenoic acid, eicosyl ester, (Z)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 534.537581492 u
Formula C36H70O2
InChI InChI=1S/C36H70O2/c1-3-5-7-9-11-13-15-17-18-19-20-21-23-25-27-29-31-33-35-38-36(37)34-32-30-28-26-24-22-16-14-12-10-8-6-4-2/h14,16H,3-13,15,17-35H2,1-2H3/b16-14-
InChIKey FIETWBRPSYJUOM-PEZBUJJGSA-N
Molecular Weight 534.954 g/mol
SMILES C(OCCCCCCCCCCCCCCCCCCCC)(CCCCCCC\C=C/CCCCCC)=O